2,20-dinitro-6,7,9,10,12,13,15,16,23,24,26,27,29,30-tetradecahydrodibenzo[b,n][1,4,7,10,13,16,19,22,25]nonaoxacycloheptacosine
Chemical Structure Depiction of
2,20-dinitro-6,7,9,10,12,13,15,16,23,24,26,27,29,30-tetradecahydrodibenzo[b,n][1,4,7,10,13,16,19,22,25]nonaoxacycloheptacosine
2,20-dinitro-6,7,9,10,12,13,15,16,23,24,26,27,29,30-tetradecahydrodibenzo[b,n][1,4,7,10,13,16,19,22,25]nonaoxacycloheptacosine
Compound characteristics
| Compound ID: | 0242-0345 |
| Compound Name: | 2,20-dinitro-6,7,9,10,12,13,15,16,23,24,26,27,29,30-tetradecahydrodibenzo[b,n][1,4,7,10,13,16,19,22,25]nonaoxacycloheptacosine |
| Molecular Weight: | 582.56 |
| Molecular Formula: | C26 H34 N2 O13 |
| Smiles: | C1COCCOc2ccc(cc2OCCOCCOCCOc2cc(ccc2OCCOCCO1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1222 |
| logD: | 1.1222 |
| logSw: | -2.0338 |
| Hydrogen bond acceptors count: | 17 |
| Polar surface area: | 138.329 |
| InChI Key: | YONVJLUCCOMDFT-UHFFFAOYSA-N |